Chemical Components in the PDB

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PDBeChem : Molecule Descriptors

 Molecule : R2U    

Encodings of molecule in descriptor strings

RecordNameProgramVersionName
1 InChI InChI 1.06 InChI=1S/6H2O.2Ru/h6*1H2;;/q;;;;;;2*+3/p-6
2 InChIKey InChI 1.06 AOQXTNLYRQGSLC-UHFFFAOYSA-H
3 SMILES CACTVS 3.385 O[Ru](O)(O)[Ru](O)(O)O
4 SMILES OpenEye OEToolkits 3.1.0.0 O[Ru](O)(O)[Ru](O)(O)O
5 Canonical SMILES CACTVS 3.385 O[Ru](O)(O)[Ru](O)(O)O
6 Canonical SMILES OpenEye OEToolkits 3.1.0.0 O[Ru](O)(O)[Ru](O)(O)O